4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=50.91376292051345 stress="-7.745666219057221 -2.663901266181042 -0.6300327276517913 -2.663901266181042 -8.384690861013686 2.121897067073638 -0.6300327276517913 2.121897067073638 -6.6271968564765125" pbc="T T F" W -0.13449789 -0.21197381 0.22277084 65.02533426 88.64417051 -69.54034209 W 1.68584377 1.68362810 0.19581920 -82.41451084 -46.54818280 -63.71520067 W 1.64685009 0.42259636 1.67626233 -39.53727637 -27.76092709 43.84450588 W -0.14597521 1.70996341 1.49207130 56.92645295 -14.33506062 89.41103687